N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide

C10H18N4O3S — CID 47363918

IUPACN-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
SMILESCC(CN1CCOCC1)NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O3S/c1-9(8-14-2-4-17-5-3-14)13-18(15,16)10-6-11-12-7-10/h6-7,9,13H,2-5,8H2,1H3,(H,11,12)
InChIKeyKRSPDDGXSNFOMI-UHFFFAOYSA-N
MW274.35 g/mol
LogP-0.59
Rot. Bonds5

About N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide

N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide (PubChem CID 47363918) has the molecular formula C10H18N4O3S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
PubChem CID47363918
Molecular FormulaC10H18N4O3S
Molecular Weight274.35 g/mol
Exact Mass274.11
IUPAC NameN-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
SMILESCC(CN1CCOCC1)NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H18N4O3S/c1-9(8-14-2-4-17-5-3-14)13-18(15,16)10-6-11-12-7-10/h6-7,9,13H,2-5,8H2,1H3,(H,11,12)
InChIKeyKRSPDDGXSNFOMI-UHFFFAOYSA-N
XLogP-0.59
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide (CID 47363918) is N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide is CC(CN1CCOCC1)NS(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The InChIKey is KRSPDDGXSNFOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3S/c1-9(8-14-2-4-17-5-3-14)13-18(15,16)10-6-11-12-7-10/h6-7,9,13H,2-5,8H2,1H3,(H,11,12).
What are the key properties of N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide has a molecular weight of 274.35 g/mol, XLogP of -0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 47363918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).